1-(15Z-tetracosenoyl)-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycerol

Properties Image MNX_ID MNXM50252 reference slm:000126671 formula C47H84O5 global charge 0 mol weight 729.184 InChIKey QSPKEBRDLGBSHO-MZDZFIIESA-N InChI InChI=1S/C47H84O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-27-29-31-33-35-37-39-41-46(49)51-44-45(43-48)52-47(50)42-40-38-36-34-32-30-28-25-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,28,30,45,48H,3-11,13,15-16,21-27,29,31-44H2,1-2H3/b14-12-,19-17-,20-18-,30-28-/t45-/m0/s1 SMILES CCCCC/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@@H](CO)COC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC MNX internals InChI (mnx) InChI=1/C47H84O5/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-27-29-31-33-35-37-39-41-46(49)51-44-45(43-48)52-47(50)42-40-38-36-34-32-30-28-25-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,28,30,45,48H,3-11,13,15-16,21-27,29,31-44H2,1-2H3/b14-12-,19-17-,20-18-,30-28-/t45-/m0/s1 SMILES (mnx) [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:27][CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][C:46](=[O:49])[O:51][CH2:44][C@H:45]([CH2:43][OH:48])[O:52][C:47]([CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32]/[CH:30]=[CH:28]\[CH2:25]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:50]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0